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719269

Sigma-Aldrich

Sodium bis(2-ethylhexyl)sulfo(succinate-13C4)

99 atom % 13C, 96% (CP)

Synonym(s):

Bis(2-ethylhexyl) sulfosuccinate-13C4 sodium salt, Docusate-13C4 sodium salt

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About This Item

Empirical Formula (Hill Notation):
13C4C16H37NaO7S
Molecular Weight:
448.53
UNSPSC Code:
12352108
PubChem Substance ID:
329763633

isotopic purity

99 atom % 13C

Assay

96% (CP)

form

solid

technique(s)

bio NMR: suitable

mass shift

M+4

SMILES string

CCCCC(CC)CO[13C](=O)[13CH2][13CH]([13C](=O)OCC(CC)CCCC)S(=O)(=O)O[Na]

InChI

1S/C20H38O7S.Na/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;/h16-18H,5-15H2,1-4H3,(H,23,24,25);/q;+1/p-1/i13+1,18+1,19+1,20+1;

InChI key

APSBXTVYXVQYAB-AZUKWMEISA-M

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

CorrosionExclamation mark
GHS05,GHS07

Signal Word

Danger

Hazard Statements

H302,H315,H318

Precautionary Statements

P280 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
IY1593

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